3-bromo-N-{[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide
Chemical Structure Depiction of
3-bromo-N-{[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide
3-bromo-N-{[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide
Compound characteristics
| Compound ID: | 4028-1330 |
| Compound Name: | 3-bromo-N-{[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl}benzamide |
| Molecular Weight: | 453.32 |
| Molecular Formula: | C20 H13 Br N4 O2 S |
| Smiles: | c1cc(cc(c1)NC(NC(c1cccc(c1)[Br])=O)=S)c1nc2c(cccn2)o1 |
| Stereo: | ACHIRAL |
| logP: | 5.0514 |
| logD: | 5.0474 |
| logSw: | -5.0209 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.424 |
| InChI Key: | DYKOEPLBDWJLOI-UHFFFAOYSA-N |